1-[5-tert-butyl-5-oxidanyl-3-(trifluoromethyl)-4H-pyrazol-1-yl]-3-phenyl-propan-1-one

Systemtic Name: 1-[5-tert-butyl-5-oxidanyl-3-(trifluoromethyl)-4H-pyrazol-1-yl]-3-phenyl-propan-1-one Openeye Name: 1-[5-tert-butyl-5-hydroxy-3-(trifluoromethyl)-4H-pyrazol-1-yl]-3-phenyl-propan-1-one CAS Name: 1-[5-tert-butyl-5-hydroxy-3-(trifluoromethyl)-4H-pyrazol-1-yl]-3-phenyl-1-propanone IUPAC Name: 1-[5-tert-butyl-5-hydroxy-3-(trifluoromethyl)-4H-pyrazol-1-yl]-3-phenylpropan-1-one Traditional Name: 1-[5-tert-butyl-5-hydroxy-3-(trifluoromethyl)-2-pyrazolin-1-yl]-3-phenyl-propan-1-one Formula: C17H21F3N2O2 MolecularWeight: 342.35605

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1(CC(=NN1C(=O)CCC2=CC=CC=C2)C(F)(F)F)O

Isomeric SMILES

CC(C)(C)C1(CC(=NN1C(=O)CCC2=CC=CC=C2)C(F)(F)F)O

InChI

InChI=1S/C17H21F3N2O2/c1-15(2,3)16(24)11-13(17(18,19)20)21-22(16)14(23)10-9-12-7-5-4-6-8-12/h4-8,24H,9-11H2,1-3H3